2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]ethanamide

Systemtic Name: 2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]ethanamide Openeye Name: 2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]acetamide CAS Name: 2-[4-(3-chlorophenyl)-1-piperazin-1-iumyl]-N-[[1-(4-morpholin-4-iumyl)cyclohexyl]methyl]acetamide IUPAC Name: 2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]acetamide Traditional Name: 2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]acetamide Formula: C23H37ClN4O2+2 MolecularWeight: 437.01848

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)C[NH+]2CCN(CC2)C3=CC(=CC=C3)Cl)[NH+]4CCOCC4

Isomeric SMILES

C1CCC(CC1)(CNC(=O)C[NH+]2CCN(CC2)C3=CC(=CC=C3)Cl)[NH+]4CCOCC4

InChI

InChI=1S/C23H35ClN4O2/c24-20-5-4-6-21(17-20)27-11-9-26(10-12-27)18-22(29)25-19-23(7-2-1-3-8-23)28-13-15-30-16-14-28/h4-6,17H,1-3,7-16,18-19H2,(H,25,29)/p+2